2-methylsulfanyl-N-[2-[1-(pyridin-2-ylmethyl)indol-3-yl]ethyl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[2-[1-(pyridin-2-ylmethyl)indol-3-yl]ethyl]pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-[2-[1-(2-pyridylmethyl)indol-3-yl]ethyl]pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[2-[1-(2-pyridinylmethyl)-3-indolyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-[2-[1-(pyridin-2-ylmethyl)indol-3-yl]ethyl]pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-[2-[1-(2-pyridylmethyl)indol-3-yl]ethyl]nicotinamide Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NCCC2=CN(C3=CC=CC=C32)CC4=CC=CC=N4

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NCCC2=CN(C3=CC=CC=C32)CC4=CC=CC=N4

InChI

InChI=1S/C23H22N4OS/c1-29-23-20(9-6-13-26-23)22(28)25-14-11-17-15-27(16-18-7-4-5-12-24-18)21-10-3-2-8-19(17)21/h2-10,12-13,15H,11,14,16H2,1H3,(H,25,28)